5-ethoxy-2-[(2-methylphenyl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 5-ethoxy-2-[(2-methylphenyl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 5-ethoxy-2-(o-tolylmethylsulfanyl)-1,3-benzothiazole CAS Name: 5-ethoxy-2-[(2-methylphenyl)methylthio]-1,3-benzothiazole IUPAC Name: 5-ethoxy-2-[(2-methylphenyl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 5-ethoxy-2-[(2-methylbenzyl)thio]-1,3-benzothiazole Formula: C17H17NOS2 MolecularWeight: 315.45298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)SC(=N2)SCC3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC2=C(C=C1)SC(=N2)SCC3=CC=CC=C3C

InChI

InChI=1S/C17H17NOS2/c1-3-19-14-8-9-16-15(10-14)18-17(21-16)20-11-13-7-5-4-6-12(13)2/h4-10H,3,11H2,1-2H3